⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30003457 | 0.82 | LMNA (0.35) | — | |
| SCHEMBL23355807 | 0.74 | — | — | |
| SCHEMBL15796765 | 0.74 | — | — | |
| SCHEMBL18910408 | 0.73 | — | — | |
| SCHEMBL30632957 | 0.72 | MMP9 (0.31) | — | |
| SCHEMBL29270200 | 0.72 | HTT (0.43) | — | |
| SCHEMBL16145065 | 0.71 | SRC (0.33) | — | |
| SCHEMBL31234346 | 0.70 | — | — | |
| SCHEMBL23094074 | 0.69 | — | — | |
| SCHEMBL20262079 | 0.69 | EPHX1 (0.55) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8092225-A | — | — | None | — | — | JP | disclosed |
| US-9765030-B2 | Benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2017-09-19 | — | — | US | disclosed |
| US-20140134235-A1 | NOVEL BENZYLAMINE DERIVATIVES AND THEIR UTILITY AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2014-05-15 | — | — | US | disclosed |
| US-8604055-B2 | Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2013-12-10 | — | — | US | disclosed |
| US-20070015758-A1 | Novel benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2007-01-18 | — | — | US | disclosed |
| JP-H0892225-A | TRIAZOLEGLYCOLIC ACID AMIDE DERIVATIVE | NISSAN CHEM IND LTD | 1996-04-09 | — | — | JP | disclosed |